N-(2-Methylphenyl)-1,2-benzoselenazol-3(2H)-one

Base Information

Chemical Name:N-(2-Methylphenyl)-1,2-benzoselenazol-3(2H)-one
CAS No.:81329-92-2
Molecular Formula:C₁₄H₁₁NOSe
Molecular Weight:288.207
Hs Code.:
ChEMBL ID:CHEMBL5094204
DSSTox Substance ID:DTXSID901235255
Nikkaji Number:J1.968.701E

Synonyms:N-(2-Methylphenyl)-1,2-benzoselenazol-3(2H)-one;CHEMBL5094204;SCHEMBL10501672;DTXSID901235255;81329-92-2;2-(2-Methylphenyl)-1,2-benzisoselenazol-3(2H)-one

Suppliers and Price of N-(2-Methylphenyl)-1,2-benzoselenazol-3(2H)-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of N-(2-Methylphenyl)-1,2-benzoselenazol-3(2H)-one

Chemical Property:

Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:289.00059
Heavy Atom Count:17
Complexity:307

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3[Se]2

Technology Process of N-(2-Methylphenyl)-1,2-benzoselenazol-3(2H)-one

There total 6 articles about N-(2-Methylphenyl)-1,2-benzoselenazol-3(2H)-one which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 62303-06-4
N-(2-methylphenyl)-o-iodobenzamide

: 81329-92-2
2-(2-methylphenyl)-1,2-benzisoselenazol-3(2H)-one

Guidance literature:: With selenium; sodium t-butanolate; In N,N-dimethyl-formamide; at 130 ℃; for 12h; Inert atmosphere;
DOI:10.1021/acs.jmedchem.1c00566

Reference yield:

: 584-70-3
N-benzoyl-2-methylaniline

: 81329-92-2
2-(2-methylphenyl)-1,2-benzisoselenazol-3(2H)-one

Guidance literature:: N-benzoyl-2-methylaniline; With n-butyllithium; In tetrahydrofuran; for 0.5h;

With selenium; In tetrahydrofuran; for 0.5h;

With copper(ll) bromide; In tetrahydrofuran; at -78 - 20 ℃;
DOI:10.1248/cpb.51.1413

Reference yield:

: 609-67-6
2-Iodobenzoyl chloride

: 95-53-4
o-toluidine

: 81329-92-2
2-(2-methylphenyl)-1,2-benzisoselenazol-3(2H)-one

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 3 h / 0 - 20 °C / Inert atmosphere

2: sodium t-butanolate; selenium / N,N-dimethyl-formamide / 12 h / 130 °C / Inert atmosphere

With selenium; triethylamine; sodium t-butanolate; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/acs.jmedchem.1c00566